Vitas-M small molecule compound

1-chloro-4-(4-chlorophenyl)-N,N-diethyl-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxamide

Catalog ID
STK551631
SMILES CCN(C(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Cl)Sc1ccccc1[N+](=O)[O-])CC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C29H29Cl2N3O3S MW 570.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29Cl2N3O3S/c1-3-33(4-2)29(35)18-11-14-22-20(15-18)26-21(28(32-22)17-9-12-19(30)13-10-17)16-25(27(26)31)38-24-8-6-5-7-23(24)34(36)37/h5-15,21,25-28,32H,3-4,16H2,1-2H3
InChIKey
WEZPTBQVLURKIX-UHFFFAOYSA-N
Synonyms

1chloro4(4chlorophenyl)NNdiethyl2((2nitrophenyl)sulfanyl)233a459bhexahydro1Hcyclopenta(c)quinoline8carboxamide
1chloro4(4chlorophenyl)NNdiethyl2((2nitrophenyl)thio)233a459bhexahydro1Hcyclopenta(c)quinoline8carboxamide
1CHLORO4(4CHLOROPHENYL)NNDIETHYL2(2NITROPHENYL)SULFANYL233A459BHEXAHYDRO1HCYCLOPENTA(C)QUINOLINE8CARBOXAMIDE
CCN(C(=O)c1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1ccc(cc1)Cl)Sc1ccccc1(N+)(=O)(O))CC
CCN(CC)C(=O)C1=CC2=C(C=C1)NC(C3C2C(C(C3)SC4=CC=CC=C4(N+)(=O)(O))Cl)C5=CC=C(C=C5)Cl
InChI=1SC29H29Cl2N3O3Sc1333(42)29(35)1811142220(1518)2621(28(3222)1791219(30)131017)1625(27(26)31)3824865723(24)34(36)37h51521252832H3416H212H3
MFCD03678100
ZINC000105791158
ZINC000229922790

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Available files

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